[1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-(4-methylpiperazin-1-yl)methanethione

Systemtic Name: [1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-(4-methylpiperazin-1-yl)methanethione Openeye Name: [1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-(4-methylpiperazin-1-yl)methanethione CAS Name: [1-[(3,4-dichlorophenyl)methyl]-3-indolyl]-(4-methyl-1-piperazinyl)methanethione IUPAC Name: [1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-(4-methylpiperazin-1-yl)methanethione Traditional Name: [1-(3,4-dichlorobenzyl)indol-3-yl]-(4-methylpiperazino)methanethione Formula: C21H21Cl2N3S MolecularWeight: 418.38254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)C2=CN(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CN1CCN(CC1)C(=S)C2=CN(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3S/c1-24-8-10-25(11-9-24)21(27)17-14-26(20-5-3-2-4-16(17)20)13-15-6-7-18(22)19(23)12-15/h2-7,12,14H,8-11,13H2,1H3